Molecular dynamic simulation of graphene reinforced nanocomposites for evaluating elastic constants

Procedia Engineering

Volumn 56, Issue , 2013, Pages 789-794

  Rahman, R ^a   Haque, A ^a  

^a Box 870280   (United States)

Author keywords

Elastic constants; Molecular mechanics; Nanocomposites

Indexed keywords

EID: 84891724374     PISSN: 18777058     EISSN: None     Source Type: Conference Proceeding    
DOI: 10.1016/j.proeng.2013.03.197     Document Type: Conference Paper

References (7)

1. A. Haque, M. Shamsuzzoha, F. Hussain and D. Dean, 2003, S2-Glass/Epoxy Polymer Nanocomposites: Manufacturing, Structures, Thermal and Mechanical Properties ", Journal of Composite Materials, 37 (20) p.1821-1837
2. Leach. Andrew, R. Molecular Modelling: Principles and Applications 1997, Addison Wesley
3. Amnaya P. Awasthi, Dimitris C. Lagoudas, Daniel C. Hammerand. 2009, Modeling of graphene-polymer interfacial mechanical behavior using molecular dynamics", Modelling and Simulation in Materials Science and Engineering, 17, p. 015002
4. http://lammps.sandia.gov/
5. Wei Chen, Gary C. Lickfield, Charles Q. Yang, 2004, Molecular modeling of cellulose in amorphous state. Part I: model building and plastic deformation study, Polymer, 45, p. 1063-1071
6. Sun H. 1998, Compass: An ab initio force field optimized for condensed phase applications - Overview with details on Alken and Benzene compounds, Journal of Physical chemistry .B 102(38), p. 7338-7364
7. Zhu R., Pan E. and Roy A.K. 2007, Molecular dynamics study of the stress-strain behavior of carbon-nanotube Epon 862 composites, Materials science and engineering A. 447, p. 51-57